| SpectraBase Compound ID | 3x2WbzX1dzC |
|---|---|
| InChI | InChI=1S/C29H42O4/c1-17(2)18-9-12-28(23(30)31)15-16-29(24(32)33)19(22(18)28)7-8-21-26(5)14-13-25(3,4)20(26)10-11-27(21,29)6/h13-14,18-22H,1,7-12,15-16H2,2-6H3,(H,30,31)(H,32,33)/t18-,19+,20-,21+,22+,26-,27+,28-,29+/m0/s1 |
| InChIKey | CMDOQXSBVNWCEM-AKDRKZOISA-N |
| Mol Weight | 454.7 g/mol |
| Molecular Formula | C29H42O4 |
| Exact Mass | 454.30831 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 7OMgFp9SeMd |
|---|---|
| Name | CEANOTHENIC-ACID |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H42O4 |
| InChI | InChI=1S/C29H42O4/c1-17(2)18-9-12-28(23(30)31)15-16-29(24(32)33)19(22(18)28)7-8-21-26(5)14-13-25(3,4)20(26)10-11-27(21,29)6/h13-14,18-22H,1,7-12,15-16H2,2-6H3,(H,30,31)(H,32,33)/t18-,19+,20-,21+,22+,26-,27+,28-,29+/m0/s1 |
| InChIKey | CMDOQXSBVNWCEM-AKDRKZOISA-N |
| Literature Reference Author | D.B.DOMINGUEZ-CARMONA,F.ESCALANTE-EROSA,K.GARCIA-SOSA,G.RUIZ -PINELL |
| Literature Reference Citation | J.BRAZ.CHEM.SOC.,22,1279(2011) |
| Literature Reference DOI | 10.1590/s0103-50532011000700013 |
| Molecular Weight | 454.650 g/mol |
| Source File Reference | UWBT5673 |